Vitas-M small molecule compound
5-({[3-(4-ethylphenoxy)propyl]amino}methylidene)-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK298950
SMILES CCc1ccc(cc1)OCCCN/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H27N3O3S MW 485.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3S/c1-2-21-14-16-24(17-15-21)34-19-9-18-29-20-25-26(32)30(22-10-5-3-6-11-22)28(35)31(27(25)33)23-12-7-4-8-13-23/h3-8,10-17,20,29H,2,9,18-19H2,1H3InChIKey
OPHSDHGCDGNDEL-UHFFFAOYSA-NSynonyms
5(((3(4ethylphenoxy)propyl)amino)methylidene)13diphenyl2thioxodihydropyrimidine46(1H5H)dione
5((3(4ethylphenoxy)propylamino)methylidene)13diphenyl2sulfanylidene13diazinane46dione
CCC1=CC=C(C=C1)OCCCNC=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4
CCc1ccc(cc1)OCCCNC=C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
InChI=1SC28H27N3O3Sc1221141624(171521)341991829202526(32)30(22105361122)28(35)31(27(25)33)23127481323h3810172029H291819H21H3
MFCD00486202
ZINC000020028333
ZINC20028333
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